1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carbothioamide

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carbothioamide Openeye Name: 1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carbothioamide CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-piperidin-1-iumcarbothioamide IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carbothioamide Traditional Name: 1-(3,4-dichlorobenzyl)piperidin-1-ium-4-carbothioamide Formula: C13H17Cl2N2S+ MolecularWeight: 304.25848

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=S)N)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1C[NH+](CCC1C(=S)N)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H16Cl2N2S/c14-11-2-1-9(7-12(11)15)8-17-5-3-10(4-6-17)13(16)18/h1-2,7,10H,3-6,8H2,(H2,16,18)/p+1